6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one
TL;DR: 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one (CAS 942007-85-4) is a chemical compound with molecular formula C12H10N2O3 and molecular weight 230.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1,3-benzodioxol-5-yl)-2-methylpyridazin-3-one
Also Known As: 6-(1,3-benzodioxol-5-yl)-2-methylpyridazin-3-one, 6-(2H-1,3-benzodioxol-5-yl)-2-methyl-2,3-dihydropyridazin-3-one, 6-(benzo[d][1,3]dioxol-5-yl)-2-methylpyridazin-3(2H)-one, F2774-1337
| Molecular Formula | C12H10N2O3 |
|---|---|
| Molecular Weight | 230.07 g/mol |
| LogP | 1.176 |
| Topological Polar Surface Area | 53.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.06914 |
| Heavy Atoms | 17 |
| Complexity | 633.8881 |
Chemical Identifiers
| CAS Number | 942007-85-4 |
|---|---|
| SMILES | CN1C(=O)C=CC(=N1)C2=CC3=C(C=C2)OCO3 |
Product Overview
6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one (CAS 942007-85-4), with molecular formula C12H10N2O3 and molecular weight 230.07 g/mol. IUPAC: 6-(1,3-benzodioxol-5-yl)-2-methylpyridazin-3-one.
Chemical Property Profile of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one
Property Insights of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one
The XLogP value of 1.176 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one. With a topological polar surface area (TPSA) of 53.35 Ų, 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one?
The CAS number of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one is 942007-85-4.
What is the molecular formula of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one?
The molecular formula of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one is C12H10N2O3.
What is the molecular weight of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one?
The molecular weight of 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one is 230.07 g/mol.
Where can I buy 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one?
You can request a quote for 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(1,3-Benzodioxol-5-yl)-2-methylpyridazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.